3-nitro-N-[(E)-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)methylideneamino]aniline

Systemtic Name: 3-nitro-N-[(E)-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)methylideneamino]aniline Openeye Name: 3-nitro-N-[(E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methyleneamino]aniline CAS Name: 3-nitro-N-[(E)-(3-phenyl-1-thiophen-2-yl-4-pyrazolyl)methylideneamino]aniline IUPAC Name: 3-nitro-N-[(E)-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)methylideneamino]aniline Traditional Name: (3-nitrophenyl)-[(E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methyleneamino]amine Formula: C20H15N5O2S MolecularWeight: 389.4304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/NC3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C20H15N5O2S/c26-25(27)18-9-4-8-17(12-18)22-21-13-16-14-24(19-10-5-11-28-19)23-20(16)15-6-2-1-3-7-15/h1-14,22H/b21-13+